basic_info |
|
| Product_Name： | CHEMDIV-BB BB51-1662 |
| EnglishSynonyms： | CHEMDIV-BB BB51-1662 |
| pro_mdlNumber： | MFCD16991204 |
| pro_acceptors： | 5 |
| pro_donors： | 2 |
| pro_smile： | CCc1cccc(c1)NC2c3ccoc3C=C(N2C)C(=O)O |
| InChi： | InChI=1S/C17H18N2O3/c1-3-11-5-4-6-12(9-11)18-16-13-7-8-22-15(13)10-14(17(20)21)19(16)2/h4-10,16,18H,3H2,1-2H3,(H,20,21) |
| InChiKey： | InChIKey=LCUUHTIPSRVJSM-UHFFFAOYSA-N |
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